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MolNFT v1 · #165258 · protein

Substrate protein interactions in the limbus region of the catalytic site of candida antarctica lipase B

6TP8: “Substrate protein interactions in the limbus region of the catalytic site of candida antarctica lipase B”. X-ray diffraction, 3 ligands (DEP, NTK, NAG). MolNFT v1 #165258 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6TP8
Type
protein
Length
951 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P41365
Ligands
DEP, NTK, NAG

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C—protein317—P41365

Ligands and binding sites

  • DEP · Diethyl phosphonate · ligand · 3 copies · chains A, B, C
  • NTK · 2,3-di(butanoyloxy)propyl butanoate · ligand · 2 copies · chains A, B, C
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 6 copies · chains A, B, C

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 6TP8 · Substrate protein interactions in the limbus region of the catalytic site of Candida… · the same entry in another collection · chain A against A, TM-score 1.00
  • P41365 · AlphaFold monomer V2.0 prediction for lipase B (P41365) · a predicted model of the same protein · chain A against A, TM-score 1.00

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